Geometry & MOs

Info

ID:	345683
PubChem CID:	127269983
Reduced:	O2N3C22H29 (1)
Stoich.:	A2B3C22D29 (1)
Weight, g/mol:	315.194677
ΔH_f, kcal/mol:	-71.0
Dipole, Da:	7.48
IP(EA), eV:	-8.61(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(cyclopropylcarbamoylamino)phenyl]cycloheptanecarboxamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)C(=O)N2CCN(CC2)C(=O)CC3=CNC4=CC=CC=C43

DOS

IR

Vibrations