Geometry & MOs

Info

ID:	412658
PubChem CID:	135085570
Reduced:	MnPN3O3C16H30 (1)
Stoich.:	ABC3D3E16F30 (1)
Weight, g/mol:	255.186435
ΔH_f, kcal/mol:	42.12
Dipole, Da:	12.34
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 2.753942
Charge, e:	0

Chem-info

IUPAC name:

2-di(propan-2-yl)phosphanyl-N-[(1-methylimidazol-2-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC(C)[PH+](CCNCC1=NC=CN1C)C(C)C.[CH-]=O.[CH-]=O.[CH-]=O.[Mn+3]

DOS

IR

Vibrations