Geometry & MOs

Info

ID:	339542
PubChem CID:	127261532
Reduced:	N4O5C27H30 (1)
Stoich.:	A4B5C27D30 (1)
Weight, g/mol:	289.132746
ΔH_f, kcal/mol:	-28.14
Dipole, Da:	2.56
IP(EA), eV:	-8.64(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z)-1-(5-amino-3,4-diphenylpyrrol-2-ylidene)guanidine

Drug info:

PubChemData

Smile

CCC(C1=CC=C(C=C1)OC)C(C2=CC=C(C=C2)OC)N(C(=O)CN)/N=C/C3=CC=CC=C3[N+](=O)[O-]

DOS

IR

Vibrations